2-[2-(1-carbamothioyl-5-oxidanylidene-3-phenyl-pyrazol-4-ylidene)hydrazinyl]phenolate

Systemtic Name: 2-[2-(1-carbamothioyl-5-oxidanylidene-3-phenyl-pyrazol-4-ylidene)hydrazinyl]phenolate Openeye Name: 2-[2-(1-carbamothioyl-5-oxo-3-phenyl-pyrazol-4-ylidene)hydrazino]phenolate CAS Name: 2-[2-(1-carbamothioyl-5-oxo-3-phenyl-4-pyrazolylidene)hydrazinyl]phenolate IUPAC Name: 2-[2-(1-carbamothioyl-5-oxo-3-phenylpyrazol-4-ylidene)hydrazinyl]phenolate Traditional Name: 2-[N'-(5-keto-3-phenyl-1-thiocarbamoyl-2-pyrazolin-4-ylidene)hydrazino]phenolate Formula: C16H12N5O2S- MolecularWeight: 338.36378

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C(=O)C2=NNC3=CC=CC=C3[O-])C(=S)N

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C(=O)C2=NNC3=CC=CC=C3[O-])C(=S)N

InChI

InChI=1S/C16H13N5O2S/c17-16(24)21-15(23)14(13(20-21)10-6-2-1-3-7-10)19-18-11-8-4-5-9-12(11)22/h1-9,18,22H,(H2,17,24)/p-1